3-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperidin-4-yl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[1-[2-(azepan-1-yl)-2-oxo-ethyl]-4-piperidyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[1-[2-(1-azepanyl)-2-oxoethyl]-4-piperidinyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[1-[2-(azepan-1-yl)-2-oxoethyl]piperidin-4-yl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[1-[2-(azepan-1-yl)-2-keto-ethyl]-4-piperidyl]-1,2,3-benzotriazin-4-one Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCC(CC2)N3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCC(CC2)N3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H27N5O2/c26-19(24-11-5-1-2-6-12-24)15-23-13-9-16(10-14-23)25-20(27)17-7-3-4-8-18(17)21-22-25/h3-4,7-8,16H,1-2,5-6,9-15H2